SCHEMBL2390773

SCHEMBL2390773

c1coc(CNc2ncnc3c2ncn3C2CCCO2)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.68
▸ RAB9A P51151 3/20 0.68
▸ SMN1; SMN2 Q16637 2/20 0.68
▸ TP53 P04637 4/20 0.58
▸ PAX8 Q06710 2/20 0.58
▸ ADORA3 P0DMS8 2/20 0.58
▸ LMNA P02545 2/20 0.58
▸ SLC29A1 Q99808 1/20 0.58
▸ MITF O75030 1/20 0.58
▸ CCNB2 O95067 1/20 0.57
▸ CDK1 P06493 1/20 0.57
▸ CCNB1 P14635 1/20 0.57
▸ CCNB3 Q8WWL7 1/20 0.57
▸ HPGD P15428 2/20 0.54
▸ CYP1A2 P05177 2/20 0.54
▸ MAPK1 P28482 3/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2391367 0.97 SMN1; SMN2 (0.73) NPC1RAB9ASMN1; SMN2TP53PAX8
SCHEMBL18587976 0.85 YTHDC1 (0.59) NPC1RAB9ASMN1; SMN2TP53PAX8
SCHEMBL29664960 0.85 YTHDC1 (0.59) NPC1RAB9ASMN1; SMN2TP53PAX8
SCHEMBL30410701 0.85 SMN1; SMN2 (0.50) NPC1RAB9ASMN1; SMN2TP53PAX8
SCHEMBL29659620 0.84 YTHDC1 (0.51) NPC1RAB9ASMN1; SMN2ADORA3CCNB2
SCHEMBL20547532 0.84 YTHDC1 (0.51) NPC1RAB9ASMN1; SMN2ADORA3CCNB2
SCHEMBL20547474 0.84 FLT3 (0.49) NPC1RAB9ASMN1; SMN2ADORA3CCNB2
SCHEMBL18587971 0.83 SMN1; SMN2 (0.64) NPC1RAB9ASMN1; SMN2TP53PAX8
SCHEMBL18587805 0.83 SMN1; SMN2 (0.64) NPC1RAB9ASMN1; SMN2TP53PAX8
SCHEMBL20547431 0.83 SMN1; SMN2 (0.48) NPC1RAB9ASMN1; SMN2TP53PAX8

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3341371-B1 ADENINE DERIVATIVES AND THEIR USE AS UV-PHOTOPROTECTIVE AGENTS UNIV PALACKEHO (CZ) 2022-06-29 — — EP disclosed
EP-3341371-A1 ADENINE DERIVATIVES AND THEIR USE AS UV-PHOTOPROTECTIVE AGENTS Univerzita Palackého V Olomouci (CZ) 2018-07-04 — — EP disclosed
WO-2017036434-A1 ADENINE DERIVATIVES AND THEIR USE AS UV-PHOTOPROTECTIVE AGENTS UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2017-03-09 — — WO disclosed
EP-2043630-B1 6, 9-DISUBSTITUTED PURINE DERIVATIVES FOR COSMETIC USE INST OF EX BOTANY ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 2016-09-07 — — EP disclosed
US-20130072505-A1 6,9-Disubstituted Purine Derivatives and Their Use for Treating Skin SZUCOVA LUCIE (CZ) 2013-03-21 — — US disclosed
US-20110224238-A1 6, 9-Disubstituted Purine Derivatives and Their Use for Treating Skin SZUCOVA LUCIE 2011-09-15 — — US disclosed
US-20100234401-A1 6,9-Disubstituted Purine Derivatives and Their Use For Treating Skin SZUCOVA LUCIE 2010-09-16 — — US disclosed
EP-2043630-A2 6, 9-DISUBSTITUTED PURINE DERIVATIVES AND THEIR USE FOR TREATING SKIN Institute of Experimental Botany, Academy of Sciences of the Czech Republic (CZ) 2009-04-08 — — EP disclosed
WO-2008008770-A2 6, 9-DISUBSTITUTED PURINE DERIVATIVES AND THEIR USE FOR TREATING SKIN INSTITUTE OF EXPERIMENTAL BOTANY, ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 2008-01-17 — — WO disclosed
US-20080009508-A1 6,9-Disubstituted Purine Derivatives And Their Use For Treating Skin INSTITUTE OF EXPERIMENTAL BOTANY, ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 2008-01-10 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100234401-A1 6,9-Disubstituted Purine Derivatives and Their Use For Treating Skin UNG, P2RY6, MPG NPC1 3196/4885RAB9A 1395/4885SMN1; SMN2 3167/4885
US-20110224238-A1 6, 9-Disubstituted Purine Derivatives and Their Use for Treating Skin UNG, P2RY6, MPG NPC1 3196/4885RAB9A 1395/4885SMN1; SMN2 3167/4885
US-20130072505-A1 6,9-Disubstituted Purine Derivatives and Their Use for Treating Skin UNG, P2RY6, MPG NPC1 3196/4885RAB9A 1395/4885SMN1; SMN2 3167/4885
US-20080009508-A1 6,9-Disubstituted Purine Derivatives And Their Use For Treating Skin UNG, P2RY6, MPG NPC1 3196/4885RAB9A 1395/4885SMN1; SMN2 3167/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback